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7b-Phthalimido-3a-methyl-3b-nitrato-cephamic 4-acid, methyl ester
SpectraBase Compound ID FlrhEpzZEC3
InChI InChI=1S/C17H15N3O8S/c1-17(28-20(25)26)7-29-15-10(14(23)19(15)11(17)16(24)27-2)18-12(21)8-5-3-4-6-9(8)13(18)22/h3-6,10-11,15H,7H2,1-2H3
InChIKey FCFIOJIEYHIFPC-UHFFFAOYSA-N
Mol Weight 421.38 g/mol
Molecular Formula C17H15N3O8S
Exact Mass 421.057986 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Zn19NHEA2V
Name 7b-Phthalimido-3a-methyl-3b-nitrato-cephamic 4-acid, methyl ester
CAS Registry Number 55450-58-3
Comments C7 AND C8 SHIFTVALUE IS CHANGED FROM 161.80 TO 167.80 PPM (A.H.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H15N3O8S
InChI InChI=1S/C17H15N3O8S/c1-17(28-20(25)26)7-29-15-10(14(23)19(15)11(17)16(24)27-2)18-12(21)8-5-3-4-6-9(8)13(18)22/h3-6,10-11,15H,7H2,1-2H3
InChIKey FCFIOJIEYHIFPC-UHFFFAOYSA-N
Instrument Name Jeol PS-100
Literature Reference S. Kukolja, N.D. Jones, D.E. Dorman, J. Org. Chem. 40, 2388 (1975).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3